O1-ethyl O4-[(3-methoxycarbonyl-4-phenyl-quinolin-2-yl)methyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(3-methoxycarbonyl-4-phenyl-quinolin-2-yl)methyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(3-methoxycarbonyl-4-phenyl-2-quinolyl)methyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(3-methoxycarbonyl-4-phenyl-2-quinolinyl)methyl] ester IUPAC Name: 1-O-ethyl 4-O-[(3-methoxycarbonyl-4-phenylquinolin-2-yl)methyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[(3-carbomethoxy-4-phenyl-2-quinolyl)methyl] ester O1-ethyl ester Formula: C24H21NO6 MolecularWeight: 419.42664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC1=NC2=CC=CC=C2C(=C1C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC1=NC2=CC=CC=C2C(=C1C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H21NO6/c1-3-30-20(26)13-14-21(27)31-15-19-23(24(28)29-2)22(16-9-5-4-6-10-16)17-11-7-8-12-18(17)25-19/h4-14H,3,15H2,1-2H3/b14-13+